Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-
TL;DR: Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- (CAS 21631-63-0) is a chemical compound with molecular formula C14H11F3N2 and molecular weight 264.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-[3-(trifluoromethyl)phenyl]benzenecarboximidamide
Also Known As: N-(alpha,alpha,alpha-Trifluoro-m-tolyl)benzamidine, Trifluoromethyl-3-phenyl-benzamidin, N-(3-trifluoromethylphenyl)-benzamidine, Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-, Benzenecarboximidamide, N-(3-(trifluoromethyl)phenyl)-
| Molecular Formula | C14H11F3N2 |
|---|---|
| Molecular Weight | 264.09 g/mol |
| LogP | 3.5 |
| Topological Polar Surface Area | 38.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 264.08743 |
| Heavy Atoms | 19 |
| Complexity | 319.0 |
Chemical Identifiers
| CAS Number | 21631-63-0 |
|---|---|
| SMILES | C1=CC=C(C=C1)C(=NC2=CC=CC(=C2)C(F)(F)F)N |
| InChIKey | OIRRVWDRLICUAY-UHFFFAOYSA-N |
Product Overview
Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- (CAS 21631-63-0), with molecular formula C14H11F3N2 and molecular weight 264.09 g/mol. IUPAC: N'-[3-(trifluoromethyl)phenyl]benzenecarboximidamide.
Chemical Property Profile of Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-
Property Insights of Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-
The XLogP value of 3.5 indicates that Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 38.4 Ų, Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-?
The CAS number of Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- is 21631-63-0.
What is the molecular formula of Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-?
The molecular formula of Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- is C14H11F3N2.
What is the molecular weight of Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-?
The molecular weight of Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- is 264.09 g/mol.
Where can I buy Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-?
You can request a quote for Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)-?
Yes, KEHONG BIO provides custom synthesis services for Benzamidine, N-(alpha,alpha,alpha-trifluoro-m-tolyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.